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CHEBI:210665 - Versicorin

ChEBI IDCHEBI:210665
ChEBI NameVersicorin
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H26O4
Net Charge0
Average Mass294.391
Monoisotopic Mass294.18311
SMILESCO[C@]1(CCO)O[C@H]2C[C@H](C)C=C3C=C[C@@](C)(O)[C@@]1(C)[C@H]32
InChIInChI=1S/C17H26O4/c1-11-9-12-5-6-15(2,19)16(3)14(12)13(10-11)21-17(16,20-4)7-8-18/h5-6,9,11,13-14,18-19H,7-8,10H2,1-4H3/t11-,13+,14-,15-,16-,17-/m1/s1
InChIKeyBKKVQYQKBXOJNU-MYXGDXFVSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (25835225)
ChEBI Ontology
Outgoing Relation(s)
Versicorin (CHEBI:210665) is a ketal (CHEBI:59777)
IUPAC Name 
(1S,3R,4R,5R,10S,12S)-3-(2-hydroxyethyl)-3-methoxy-4,5,10-trimethyl-2-oxatricyclo[6.3.1.04,12]dodeca-6,8-dien-5-ol
Manual XrefsDatabases
78437965ChemSpider